Basic information
- CAS
7799-35-1- Standard SMILES
CCCCSc1ccc(C(SCCN(C)C)c2ccc(C)cc2)cc1- InChIKey
CEIPSXIKBHCSKQ-UHFFFAOYSA-N- Molecular formula
- C22H31NS2
- Average molar mass
- 373.6 g/mol
- Monoisotopic mass
- 373.18979234
Names & identifiers
- Preferred name
- Ethylamine, 2-((p-(butylthio)-alpha-(p-tolyl)benzyl)thio)-N,N-dimethyl-
- IUPAC
- 2-[(4-butylsulfanylphenyl)-(4-methylphenyl)methyl]sulfanyl-N,N-dimethylethanamine
Names & synonyms
VUFB2360BRN 22987257799-35-1ETHYLAMINE, 2-((p-(BUTYLTHIO)-alpha-(p-TOLYL)BENZYL)THIO)-N,N-DIMETHYL-2-((p-(Butylthio)-alpha-(p-tolyl)benzyl)thio)-N,N-dimethylethylamineRefChem:345106DTXSID609992442-({[4-(Butylsulfanyl)phenyl](4-methylphenyl)methyl}sulfanyl)-N,N-dimethylethan-1-amine
Database identifiers
- CAS
7799-35-1- PubChem CID
- 24652
- DTXSID
DTXSID60999244
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 53.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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